Home Other Building Blocks (S)-(+)-3-METHYL-2-BUTANOL

(S)-(+)-3-METHYL-2-BUTANOL

CAS No.:
1517-66-4
Catalog Number:
AG003CH9
Molecular Formula:
C5H12O
Molecular Weight:
88.1482
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Product Description
Catalog Number:
AG003CH9
Chemical Name:
(S)-(+)-3-METHYL-2-BUTANOL
CAS Number:
1517-66-4
Molecular Formula:
C5H12O
Molecular Weight:
88.1482
MDL Number:
MFCD00064271
IUPAC Name:
(2S)-3-methylbutan-2-ol
InChI:
InChI=1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3/t5-/m0/s1
InChI Key:
MXLMTQWGSQIYOW-YFKPBYRVSA-N
SMILES:
C[C@@H](C(C)C)O
Properties
Complexity:
32.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
88.089g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
88.15g/mol
Monoisotopic Mass:
88.089g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties